SCHEMBL4414566

SCHEMBL4414566

Cc1cn(CC(=O)N(CCNS(=O)(=O)c2nnc(-c3ccc(Cl)cc3)s2)CC(=O)O)c(=O)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
TK1 P04183 2/20 0.37
TK2 O00142 1/20 0.34
HPGD P15428 1/20 0.33
PTPRB P23467 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
PLA2G7 Q13093 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4414797 0.93 TK1 (0.37) CA12CA1CA2CA9TK1
SCHEMBL4415591 0.93 CA12 (0.37) CA12CA1CA2CA9TK1
SCHEMBL4418155 0.90 TK2 (0.33) CA12CA1CA2CA9TK1
SCHEMBL4425387 0.90 TK1 (0.33) CA12CA1CA2CA9TK1
SCHEMBL4414309 0.86 TK1 (0.36) CA12CA1CA2CA9TK1
SCHEMBL4419177 0.86 CA12 (0.32) CA12CA1CA2CA9TK2
SCHEMBL4411449 0.83 LMNA (0.33)
SCHEMBL4412301 0.83 KMT2A (0.33) CA12CA1CA2CA9TK1
SCHEMBL4415959 0.83 DDX3X (0.34) CA12CA1CA2CA9TK1
SCHEMBL4412201 0.83 RAB9A (0.37) PTPRBCYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651642-B1 PNA MONOMER AND PRECURSOR PANAGENE INC (KR) 2009-11-04 EP disclosed
US-7211668-B2 PNA monomer and precursor PANAGENE, INC. (KR) 2007-05-01 US disclosed
EP-1651642-A4 PNA MONOMER AND PRECURSOR PANAGENE INC (KR) 2006-11-29 EP disclosed
EP-1651642-A1 PNA MONOMER AND PRECURSOR Panagene Inc. (KR) 2006-05-03 EP disclosed
US-20050026930-A1 PNA monomer and precursor PANAGENE, INC. (KR) 2005-02-03 US disclosed
WO-2005009998-A1 PNA MONOMER AND PRECURSOR PANAGENE INC. (US) 2005-02-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050026930-A1 PNA monomer and precursor RNGTT, POLL, NSUN3 CA12 3059/4885CA1 1963/4885CA2 3196/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.